N-(3,5-ditert-butyl-4-oxidanyl-phenyl)-4-ethoxy-2-nitro-benzenesulfonamide

Systemtic Name: N-(3,5-ditert-butyl-4-oxidanyl-phenyl)-4-ethoxy-2-nitro-benzenesulfonamide Openeye Name: N-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-ethoxy-2-nitro-benzenesulfonamide CAS Name: N-(3,5-ditert-butyl-4-hydroxyphenyl)-4-ethoxy-2-nitrobenzenesulfonamide IUPAC Name: N-(3,5-ditert-butyl-4-hydroxyphenyl)-4-ethoxy-2-nitrobenzenesulfonamide Traditional Name: N-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-ethoxy-2-nitro-benzenesulfonamide Formula: C22H30N2O6S MolecularWeight: 450.5484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)S(=O)(=O)NC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)S(=O)(=O)NC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H30N2O6S/c1-8-30-15-9-10-19(18(13-15)24(26)27)31(28,29)23-14-11-16(21(2,3)4)20(25)17(12-14)22(5,6)7/h9-13,23,25H,8H2,1-7H3